About acetonitrile;4-chloro-5-fluoroquinazoline;deuterio(fluoro)methane;3,3-difluoro-1-methylpiperidin-4-ol;5-fluoro-N-[3-methyl-4-(1-methylbenzimidazol-5-yl)oxyphenyl]quinazolin-4-amine;1-fluoro-2-methyl-4-nitrobenzene;4-methoxy-1-N-methylbenzene-1,2-diamine;5-methoxy-1-methylbenzimidazole;4-methoxy-N-methyl-2-nitroaniline;4-methoxy-2-nitroaniline;1-methylbenzimidazol-5-ol;3-methyl-4-(1-methylbenzimidazol-5-yl)oxyaniline;1-methyl-5-(2-methyl-4-nitrophenoxy)benzimidazole
acetonitrile;4-chloro-5-fluoroquinazoline;deuterio(fluoro)methane;3,3-difluoro-1-methylpiperidin-4-ol;5-fluoro-N-[3-methyl-4-(1-methylbenzimidazol-5-yl)oxyphenyl]quinazolin-4-amine;1-fluoro-2-methyl-4-nitrobenzene;4-methoxy-1-N-methylbenzene-1,2-diamine;5-methoxy-1-methylbenzimidazole;4-methoxy-N-methyl-2-nitroaniline;4-methoxy-2-nitroaniline;1-methylbenzimidazol-5-ol;3-methyl-4-(1-methylbenzimidazol-5-yl)oxyaniline;1-methyl-5-(2-methyl-4-nitrophenoxy)benzimidazole (PubChem CID 167701708) has the molecular formula C117H121ClF6N26O17
and a molecular weight of 2313.87 g/mol. Its IUPAC name is acetonitrile;4-chloro-5-fluoroquinazoline;deuterio(fluoro)methane;3,3-difluoro-1-methylpiperidin-4-ol;5-fluoro-N-[3-methyl-4-(1-methylbenzimidazol-5-yl)oxyphenyl]quinazolin-4-amine;1-fluoro-2-methyl-4-nitrobenzene;4-methoxy-1-N-methylbenzene-1,2-diamine;5-methoxy-1-methylbenzimidazole;4-methoxy-N-methyl-2-nitroaniline;4-methoxy-2-nitroaniline;1-methylbenzimidazol-5-ol;3-methyl-4-(1-methylbenzimidazol-5-yl)oxyaniline;1-methyl-5-(2-methyl-4-nitrophenoxy)benzimidazole.
Analyze acetonitrile;4-chloro-5-fluoroquinazoline;deuterio(fluoro)methane;3,3-difluoro-1-methylpiperidin-4-ol;5-fluoro-N-[3-methyl-4-(1-methylbenzimidazol-5-yl)oxyphenyl]quinazolin-4-amine;1-fluoro-2-methyl-4-nitrobenzene;4-methoxy-1-N-methylbenzene-1,2-diamine;5-methoxy-1-methylbenzimidazole;4-methoxy-N-methyl-2-nitroaniline;4-methoxy-2-nitroaniline;1-methylbenzimidazol-5-ol;3-methyl-4-(1-methylbenzimidazol-5-yl)oxyaniline;1-methyl-5-(2-methyl-4-nitrophenoxy)benzimidazole with MolForge
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Frequently Asked Questions
What is the IUPAC name of acetonitrile;4-chloro-5-fluoroquinazoline;deuterio(fluoro)methane;3,3-difluoro-1-methylpiperidin-4-ol;5-fluoro-N-[3-methyl-4-(1-methylbenzimidazol-5-yl)oxyphenyl]quinazolin-4-amine;1-fluoro-2-methyl-4-nitrobenzene;4-methoxy-1-N-methylbenzene-1,2-diamine;5-methoxy-1-methylbenzimidazole;4-methoxy-N-methyl-2-nitroaniline;4-methoxy-2-nitroaniline;1-methylbenzimidazol-5-ol;3-methyl-4-(1-methylbenzimidazol-5-yl)oxyaniline;1-methyl-5-(2-methyl-4-nitrophenoxy)benzimidazole?
The IUPAC name of acetonitrile;4-chloro-5-fluoroquinazoline;deuterio(fluoro)methane;3,3-difluoro-1-methylpiperidin-4-ol;5-fluoro-N-[3-methyl-4-(1-methylbenzimidazol-5-yl)oxyphenyl]quinazolin-4-amine;1-fluoro-2-methyl-4-nitrobenzene;4-methoxy-1-N-methylbenzene-1,2-diamine;5-methoxy-1-methylbenzimidazole;4-methoxy-N-methyl-2-nitroaniline;4-methoxy-2-nitroaniline;1-methylbenzimidazol-5-ol;3-methyl-4-(1-methylbenzimidazol-5-yl)oxyaniline;1-methyl-5-(2-methyl-4-nitrophenoxy)benzimidazole (CID 167701708) is acetonitrile;4-chloro-5-fluoroquinazoline;deuterio(fluoro)methane;3,3-difluoro-1-methylpiperidin-4-ol;5-fluoro-N-[3-methyl-4-(1-methylbenzimidazol-5-yl)oxyphenyl]quinazolin-4-amine;1-fluoro-2-methyl-4-nitrobenzene;4-methoxy-1-N-methylbenzene-1,2-diamine;5-methoxy-1-methylbenzimidazole;4-methoxy-N-methyl-2-nitroaniline;4-methoxy-2-nitroaniline;1-methylbenzimidazol-5-ol;3-methyl-4-(1-methylbenzimidazol-5-yl)oxyaniline;1-methyl-5-(2-methyl-4-nitrophenoxy)benzimidazole.
What is the SMILES notation for acetonitrile;4-chloro-5-fluoroquinazoline;deuterio(fluoro)methane;3,3-difluoro-1-methylpiperidin-4-ol;5-fluoro-N-[3-methyl-4-(1-methylbenzimidazol-5-yl)oxyphenyl]quinazolin-4-amine;1-fluoro-2-methyl-4-nitrobenzene;4-methoxy-1-N-methylbenzene-1,2-diamine;5-methoxy-1-methylbenzimidazole;4-methoxy-N-methyl-2-nitroaniline;4-methoxy-2-nitroaniline;1-methylbenzimidazol-5-ol;3-methyl-4-(1-methylbenzimidazol-5-yl)oxyaniline;1-methyl-5-(2-methyl-4-nitrophenoxy)benzimidazole?
The canonical SMILES for acetonitrile;4-chloro-5-fluoroquinazoline;deuterio(fluoro)methane;3,3-difluoro-1-methylpiperidin-4-ol;5-fluoro-N-[3-methyl-4-(1-methylbenzimidazol-5-yl)oxyphenyl]quinazolin-4-amine;1-fluoro-2-methyl-4-nitrobenzene;4-methoxy-1-N-methylbenzene-1,2-diamine;5-methoxy-1-methylbenzimidazole;4-methoxy-N-methyl-2-nitroaniline;4-methoxy-2-nitroaniline;1-methylbenzimidazol-5-ol;3-methyl-4-(1-methylbenzimidazol-5-yl)oxyaniline;1-methyl-5-(2-methyl-4-nitrophenoxy)benzimidazole is CC#N.CN1CCC(O)C(F)(F)C1.CNc1ccc(OC)cc1N.CNc1ccc(OC)cc1[N+](=O)[O-].COc1ccc(N)c([N+](=O)[O-])c1.COc1ccc2c(c1)ncn2C.Cc1cc(N)ccc1Oc1ccc2c(c1)ncn2C.Cc1cc(Nc2ncnc3cccc(F)c23)ccc1Oc1ccc2c(c1)ncn2C.Cc1cc([N+](=O)[O-])ccc1F.Cc1cc([N+](=O)[O-])ccc1Oc1ccc2c(c1)ncn2C.Cn1cnc2cc(O)ccc21.Fc1cccc2ncnc(Cl)c12.[2H]CF.
What is the InChIKey of acetonitrile;4-chloro-5-fluoroquinazoline;deuterio(fluoro)methane;3,3-difluoro-1-methylpiperidin-4-ol;5-fluoro-N-[3-methyl-4-(1-methylbenzimidazol-5-yl)oxyphenyl]quinazolin-4-amine;1-fluoro-2-methyl-4-nitrobenzene;4-methoxy-1-N-methylbenzene-1,2-diamine;5-methoxy-1-methylbenzimidazole;4-methoxy-N-methyl-2-nitroaniline;4-methoxy-2-nitroaniline;1-methylbenzimidazol-5-ol;3-methyl-4-(1-methylbenzimidazol-5-yl)oxyaniline;1-methyl-5-(2-methyl-4-nitrophenoxy)benzimidazole?
The InChIKey is YMHXUPNEQQRCMS-YTIVGADBSA-N. The full InChI is InChI=1S/C23H18FN5O.C15H13N3O3.C15H15N3O.C9H10N2O.C8H4ClFN2.C8H10N2O3.C8H8N2O.C8H12N2O.C7H6FNO2.C7H8N2O3.C6H11F2NO.C2H3N.CH3F/c1-14-10-15(28-23-22-17(24)4-3-5-18(22)25-12-26-23)6-9-21(14)30-16-7-8-20-19(11-16)27-13-29(20)2;1-10-7-11(18(19)20)3-6-15(10)21-12-4-5-14-13(8-12)16-9-17(14)2;1-10-7-11(16)3-6-15(10)19-12-4-5-14-13(8-12)17-9-18(14)2;1-11-6-10-8-5-7(12-2)3-4-9(8)11;9-8-7-5(10)2-1-3-6(7)11-4-12-8;1-9-7-4-3-6(13-2)5-8(7)10(11)12;1-10-5-9-7-4-6(11)2-3-8(7)10;1-10-8-4-3-6(11-2)5-7(8)9;1-5-4-6(9(10)11)2-3-7(5)8;1-12-5-2-3-6(8)7(4-5)9(10)11;1-9-3-2-5(10)6(7,8)4-9;1-2-3;1-2/h3-13H,1-2H3,(H,25,26,28);3-9H,1-2H3;3-9H,16H2,1-2H3;3-6H,1-2H3;1-4H;3-5,9H,1-2H3;2-5,11H,1H3;3-5,10H,9H2,1-2H3;2-4H,1H3;2-4H,8H2,1H3;5,10H,2-4H2,1H3;1H3;1H3/i;;;;;;;;;;;;1D.
What are the key properties of acetonitrile;4-chloro-5-fluoroquinazoline;deuterio(fluoro)methane;3,3-difluoro-1-methylpiperidin-4-ol;5-fluoro-N-[3-methyl-4-(1-methylbenzimidazol-5-yl)oxyphenyl]quinazolin-4-amine;1-fluoro-2-methyl-4-nitrobenzene;4-methoxy-1-N-methylbenzene-1,2-diamine;5-methoxy-1-methylbenzimidazole;4-methoxy-N-methyl-2-nitroaniline;4-methoxy-2-nitroaniline;1-methylbenzimidazol-5-ol;3-methyl-4-(1-methylbenzimidazol-5-yl)oxyaniline;1-methyl-5-(2-methyl-4-nitrophenoxy)benzimidazole?
acetonitrile;4-chloro-5-fluoroquinazoline;deuterio(fluoro)methane;3,3-difluoro-1-methylpiperidin-4-ol;5-fluoro-N-[3-methyl-4-(1-methylbenzimidazol-5-yl)oxyphenyl]quinazolin-4-amine;1-fluoro-2-methyl-4-nitrobenzene;4-methoxy-1-N-methylbenzene-1,2-diamine;5-methoxy-1-methylbenzimidazole;4-methoxy-N-methyl-2-nitroaniline;4-methoxy-2-nitroaniline;1-methylbenzimidazol-5-ol;3-methyl-4-(1-methylbenzimidazol-5-yl)oxyaniline;1-methyl-5-(2-methyl-4-nitrophenoxy)benzimidazole has a molecular weight of 2313.87 g/mol, XLogP of 25.25, 18 rotatable bonds, 8 hydrogen bond donors, and 39 hydrogen bond acceptors.
Where does this data come from?
All data for acetonitrile;4-chloro-5-fluoroquinazoline;deuterio(fluoro)methane;3,3-difluoro-1-methylpiperidin-4-ol;5-fluoro-N-[3-methyl-4-(1-methylbenzimidazol-5-yl)oxyphenyl]quinazolin-4-amine;1-fluoro-2-methyl-4-nitrobenzene;4-methoxy-1-N-methylbenzene-1,2-diamine;5-methoxy-1-methylbenzimidazole;4-methoxy-N-methyl-2-nitroaniline;4-methoxy-2-nitroaniline;1-methylbenzimidazol-5-ol;3-methyl-4-(1-methylbenzimidazol-5-yl)oxyaniline;1-methyl-5-(2-methyl-4-nitrophenoxy)benzimidazole is sourced from PubChem (CID 167701708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).